AC1Q2VIH
N-(4-butylphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
Also Known As: N-(4-butylphenyl)-2-{[5-(furan-2-yl)-4-(prop-2-en-1-yl)-4H-1,2,4-triazol-3-yl]sulfanyl}acetamide|2-((4-allyl-5-(furan-2-yl)-4H-1,2,4-triazol-3-yl)thio)-N-(4-butylphenyl)acetamide|N-(4-butylphenyl)-2-(5-(2-furyl)-4-prop-2-enyl(1,2,4-triazol-3-ylthio))acetami de|N-(4-butylphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide
| Molecular Formula | C21H24N4O2S |
|---|---|
| Molecular Weight | 396.162 g/mol |
| LogP | 4.7975 |
| Topological Polar Surface Area | 72.95 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 10 |
| Exact Mass | 396.162 |
| Monoisotopic Mass | 396.162 |
| Heavy Atoms | 28 |
| Complexity | 901.1459 |
Chemical Identifiers
| CAS Number | 577960-34-0 |
|---|---|
| SMILES | CCCCC1=CC=C(C=C1)NC(=O)CSC2=NN=C(N2CC=C)C3=CC=CO3 |
Product Overview
AC1Q2VIH (CAS 577960-34-0), with molecular formula C21H24N4O2S and molecular weight 396.162 g/mol. IUPAC: N-(4-butylphenyl)-2-[[5-(furan-2-yl)-4-prop-2-enyl-1,2,4-triazol-3-yl]sulfanyl]acetamide.
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